9-Chloracridin

9-Chloroacridine

HCID 71013

Notizen Reaktionen

Teilstruktursuche Ähnliche Strukturen suchen

Grundinformationen

CAS: 1207-69-8
Standard-SMILES: Clc1c2ccccc2nc2ccccc12
InChIKey: BPXINCHFOLVVSG-UHFFFAOYSA-N
Summenformel: C13H8ClN
Durchschnittliche Molmasse: 213,66 g/mol
Monoisotopische Masse: 213,034527

Namen und Bezeichner

Bevorzugter Name: 9-Chloroacridine
IUPAC: 9-chloroacridine
Lokaler Name: 9-Chloracridin
Englischer Name: 9-Chloroacridine
Summenformel: C13H8ClN
Molmasse: 213.66

Namen und Synonyme

9-Chloroacridine1207-69-8Acridine, 9-chloro-DTXSID4061622RefChem:107798DTXCID2033657214-895-29-chloro-acridineMFCD000222669-ChloracridinEINECS 214-895-2NSC 51950

Weitere Namen anzeigen

AURORA KA-43039-chloracridine9-chloroacridone9-Chloroacridine,95%9-CHLOROACRIDINE 95%9-Chloroacridine, GC 95%9-Chloroacridine/9-Chloroacridine

SCHEMBL455949AI3-52323CHEMBL2180144NSC51950NSC-51950AKOS001443923D70153BCP14588

Datenbank-Bezeichner

CAS: 1207-69-8
PubChem CID: 71013
DTXSID: DTXSID4061622
ChEMBL: CHEMBL2180144
EC Number: 214-895-2
Nikkaji: J217.057D

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 4,2
Polarare Oberfläche (TPSA): 12,9 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 0
Schwere Atome: 15
Formalladung: 0
Komplexität: 209

Physikochemische Eigenschaften

Schmelzpunkt: 116 · 116-120 °C (lit.)
Siedepunkt: 346.74 °C · 346.74°C (rough estimate)
Dichte: 1.1961 · 1.1961 (rough estimate)
Brechungsindex: 1.5868 · 1.5868 (estimate)
storage temp.: Keep in dark place,Sealed in dry,Room Temperature
Aggregatzustand: solid
pka: 3.96 · 3.96±0.10(Predicted)
InChI: InChI=1S/C13H8ClN/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1-8H
InChIKey: BPXINCHFOLVVSG-UHFFFAOYSA-N
SMILES: C1C2C(=NC3C(C=2Cl)=CC=CC=3)C=CC=1
CAS Datenbank: 1207 · 1207-69-8(CAS DataBase Reference)
NIST chemische Informationen: 9 · Acridine, 9-chloro-(1207-69-8)
EPA chemische Informationen: 9 · Acridine, 9-chloro- (1207-69-8)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.6%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 42 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Gefahrenhinweise

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (97.6%)

Sicherheitsdaten

wgk: 3
tsca: TSCA listed
ridadr: UN2811
hs_code: 29379000
risk_code: 36/37/38-22
hazard_code: Xi,Xn
safety_code: 26-36-37/39
Speicherklasse: 11 - Combustible Solids
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3

Chemie und Industrie

Verwendung und Herstellung

General Manufacturing InformationAcridine, 9-chloro-: ACTIVE

Anwendungen · 1 Eintrag

Verwenden9-Chloroacridine was employed as chromogenic reagent in the spectrophotometric method for the quantitative determination of dapsone. It was also used in the synthesis of:series of novel chalcones bearing acridine moiety attached to the amino group in their ring Anew acridine derivatives9-phenoxyacridine and 4-phenoxyfuro[2,3-b]quinoline derivatives